prop-2-enyl 2-[[cyclohexyl-(2-oxidanyl-3-prop-2-ynoxy-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl 2-[[cyclohexyl-(2-oxidanyl-3-prop-2-ynoxy-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[cyclohexyl-(2-hydroxy-3-prop-2-ynoxy-propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[cyclohexyl-(2-hydroxy-3-prop-2-ynoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[cyclohexyl-(2-hydroxy-3-prop-2-ynoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[cyclohexyl-(2-hydroxy-3-propargyloxy-propyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC#C)O)C3CCCCC3)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC#C)O)C3CCCCC3)C(=O)OCC=C

InChI

InChI=1S/C24H31N3O5S/c1-4-11-31-15-18(28)13-27(17-9-7-6-8-10-17)14-19-25-22(29)20-16(3)21(33-23(20)26-19)24(30)32-12-5-2/h1,5,17-18,28H,2,6-15H2,3H3,(H,25,26,29)